AB00435133-05
TL;DR: AB00435133-05 (CAS 868220-53-5) is a chemical compound with molecular formula C21H21N5O4S and molecular weight 439.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
furan-2-yl-[4-[(6-hydroxy-[1,3]thiazolo[3,2-b][1,2,4]triazol-5-yl)-(3-methoxyphenyl)methyl]piperazin-1-yl]methanone
Also Known As: AB00435133-05, AB00435133-10, F1805-0234, 5-{[4-(furan-2-carbonyl)piperazin-1-yl](3-methoxyphenyl)methyl}-[1,2,4]triazolo[3,2-b][1,3]thiazol-6-ol, furan-2-yl(4-((6-hydroxythiazolo[3,2-b][1,2,4]triazol-5-yl)(3-methoxyphenyl)methyl)piperazin-1-yl)methanone
| Molecular Formula | C21H21N5O4S |
|---|---|
| Molecular Weight | 439.13 g/mol |
| LogP | 2.6454 |
| Topological Polar Surface Area | 96.34 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 439.13144 |
| Heavy Atoms | 31 |
| Complexity | 1193.7888 |
Chemical Identifiers
| CAS Number | 868220-53-5 |
|---|---|
| SMILES | COC1=CC=CC(=C1)C(C2=C(N3C(=NC=N3)S2)O)N4CCN(CC4)C(=O)C5=CC=CO5 |
Product Overview
AB00435133-05 (CAS 868220-53-5), with molecular formula C21H21N5O4S and molecular weight 439.13 g/mol. IUPAC: furan-2-yl-[4-[(6-hydroxy-[1,3]thiazolo[3,2-b][1,2,4]triazol-5-yl)-(3-methoxyphenyl)methyl]piperazin-1-yl]methanone.
Chemical Property Profile of AB00435133-05
Property Insights of AB00435133-05
The XLogP value of 2.6454 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00435133-05. The TPSA of 96.34 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00435133-05. Following Lipinski's Rule of Five, AB00435133-05 has 1 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AB00435133-05?
The CAS number of AB00435133-05 is 868220-53-5.
What is the molecular formula of AB00435133-05?
The molecular formula of AB00435133-05 is C21H21N5O4S.
What is the molecular weight of AB00435133-05?
The molecular weight of AB00435133-05 is 439.13 g/mol.
Where can I buy AB00435133-05?
You can request a quote for AB00435133-05 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00435133-05?
Yes, KEHONG BIO provides custom synthesis services for AB00435133-05 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.